SCHEMBL8674512

SCHEMBL8674512

CCCc1cc(-c2ccccc2)c(CCC)c(CCC)c1CCC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
LTB4R Q15722 3/20 0.38
LTB4R2 Q9NPC1 3/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
MAPT P10636 1/20 0.36
PPARG P37231 2/20 0.35
BACE1 P56817 1/20 0.34
DPP4 P27487 1/20 0.34
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
CTSK P43235 1/20 0.34
PSMB5 P28074 1/20 0.34
SREBF2 Q12772 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8674735 0.86 PSMB5 (0.44) LTB4RLTB4R2ADORA3PDCD1CD274
SCHEMBL4506021 0.83 KDM4E (0.40) KDM4EALDH1A1GAAHPGDLTB4R
SCHEMBL4279832 0.83 LIPG (0.44) MAPTPSMB5
SCHEMBL22497560 0.81 LTB4R (0.41) KDM4EALDH1A1GAAHPGDLTB4R
SCHEMBL28166881 0.79 ALDH1A1 (0.42) KDM4EALDH1A1GAAHPGDADORA3
SCHEMBL27948004 0.77 PSMB5 (0.49) HPGDPSMB5
SCHEMBL27747958 0.76 TAAR1 (0.44) BACE1DPP4PSMB5
SCHEMBL6139588 0.76 PDCD1 (0.47) KDM4EALDH1A1GAAHPGDLTB4R
SCHEMBL27681638 0.75 BACE1 (0.50) KDM4EALDH1A1GAAHPGDLTB4R
SCHEMBL28581876 0.75 NPC1 (0.44) KDM4EALDH1A1GAAHPGDMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104557532-B Bigeminy benzene derivative and its application 西安力邦制药有限公司 2017-03-01 CN disclosed
CN-104557532-A Biphenyl derivative and application thereof XI AN LIBANG PHARMACEUTICAL CO LTD 2015-04-29 CN disclosed
US-5847040-A Lower alkyl biphenyls as plasticizers for polyurethane KOCH INDUSTRIES, INC. (US) 1998-12-08 US disclosed
US-5696184-A EPOXY POLYMER CONTAINING DIISOPROPYLBIPHENYL AND/OR TRIISOPROPYLBIPHENYL; INCREASED FLEXIBILITY AND TOUGHNESS KOCH INDUSTRIES, INC. (US) 1997-12-09 US disclosed
US-5489646-A CAN USE HIGH LOAD LEVELS KOCH INDUSTRIES, INC. (US) 1996-02-06 US disclosed